General Information of the Compound
| Compound ID |
CP0526612
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| Compound Name |
ethyl 1-(3-ethoxy-3-oxopropyl)-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxylate
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| Structure |
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| Formula |
C19H26N4O5
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| Molecular Weight |
390.44
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| Canonical SMILES |
CCOC(=O)CCn1ncc2c(NC3CCOCC3)c(cnc12)C(=O)OCC
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| InChI |
InChI=1S/C19H26N4O5/c1-3-27-16(24)5-8-23-18-14(12-21-23)17(22-13-6-9-26-10-7-13)15(11-20-18)19(25)28-4-2/h11-13H,3-10H2,1-2H3,(H,20,22)
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| InChIKey |
UQMFFGIPCYDMMM-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound